ethyl 3-[(3-chloranyl-2-methyl-phenyl)carbamothioylamino]benzoate

Systemtic Name: ethyl 3-[(3-chloranyl-2-methyl-phenyl)carbamothioylamino]benzoate Openeye Name: ethyl 3-[(3-chloro-2-methyl-phenyl)carbamothioylamino]benzoate CAS Name: 3-[[(3-chloro-2-methylanilino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(3-chloro-2-methylphenyl)carbamothioylamino]benzoate Traditional Name: 3-[(3-chloro-2-methyl-phenyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C17H17ClN2O2S MolecularWeight: 348.84708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=S)NC2=C(C(=CC=C2)Cl)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=S)NC2=C(C(=CC=C2)Cl)C

InChI

InChI=1S/C17H17ClN2O2S/c1-3-22-16(21)12-6-4-7-13(10-12)19-17(23)20-15-9-5-8-14(18)11(15)2/h4-10H,3H2,1-2H3,(H2,19,20,23)